![5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline structure](/static/products/3312/331244-66-7.webp)
5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline
TL;DR: 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline (CAS 331244-66-7) is a chemical compound with molecular formula C13H16N4 and molecular weight 228.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline
Also Known As: 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline, 5,5,8,9-tetramethyl-5,6-dihydrotetrazolo[5,1-a]isoquinoline, 5,5,8,9-tetramethyl-5,6-dihydrotetraazolo[5,1-a]isoquinoline
| Molecular Formula | C13H16N4 |
|---|---|
| Molecular Weight | 228.14 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.1375 |
| Heavy Atoms | 17 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 331244-66-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)C3=NN=NN3C(C2)(C)C |
| InChIKey | YDJJMCJGWZVWJF-UHFFFAOYSA-N |
Product Overview
5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline (CAS 331244-66-7), with molecular formula C13H16N4 and molecular weight 228.14 g/mol. IUPAC: 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline.
Chemical Property Profile of 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline
Property Insights of 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline. With a topological polar surface area (TPSA) of 43.6 Ų, 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline?
The CAS number of 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline is 331244-66-7.
What is the molecular formula of 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline?
The molecular formula of 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline is C13H16N4.
What is the molecular weight of 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline?
The molecular weight of 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline is 228.14 g/mol.
Where can I buy 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline?
You can request a quote for 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 5,5,8,9-tetramethyl-6H-tetrazolo[5,1-a]isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.